N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide

C16H17FN2O — CID 110472200

IUPACN-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)NC(C)(C)c2cccc(F)c2)n1
InChIInChI=1S/C16H17FN2O/c1-11-6-4-9-14(18-11)15(20)19-16(2,3)12-7-5-8-13(17)10-12/h4-10H,1-3H3,(H,19,20)
InChIKeyBQWBJBFZVWWWTN-UHFFFAOYSA-N
MW272.32 g/mol
LogP3.19
Rot. Bonds3

About N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide

N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide (PubChem CID 110472200) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide
PubChem CID110472200
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC NameN-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)NC(C)(C)c2cccc(F)c2)n1
InChIInChI=1S/C16H17FN2O/c1-11-6-4-9-14(18-11)15(20)19-16(2,3)12-7-5-8-13(17)10-12/h4-10H,1-3H3,(H,19,20)
InChIKeyBQWBJBFZVWWWTN-UHFFFAOYSA-N
XLogP3.19
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(3-fluorophenyl)propan-2-yl]-1,3-thiazole-4-carboxamide
CID 110471801
N-[2-(3-fluorophenyl)propan-2-yl]-2-methylpropanamide
CID 110470332
N-[2-(3-fluorophenyl)propan-2-yl]-2-phenylacetamide
CID 12790289
N-(1-chloro-2-methylpropan-2-yl)-6-methylpyridine-2-carboxamide
CID 114295056
(2S)-2-amino-N-[2-(3-fluorophenyl)propan-2-yl]propanamide
CID 119330298
N-[(2S)-2-(2,4-difluorophenyl)-2-hydroxypropyl]-6-methylpyridine-2-carboxamide
CID 95627816
3-fluoro-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]benzamide
CID 110472495
N-[1-bromo-2-(bromomethyl)butan-2-yl]-6-methylpyridine-2-carboxamide
CID 107868094
2-[2-(3-fluorophenyl)propan-2-ylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120976301
(4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone
CID 63554344
6-methyl-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)pyridine-2-carboxamide
CID 136518357
N-[2-(3-fluorophenyl)propan-2-yl]-1-pyridin-3-ylpyrazole-4-carboxamide
CID 122143963

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide?
The IUPAC name of N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide (CID 110472200) is N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)NC(C)(C)c2cccc(F)c2)n1.
What is the InChIKey of N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide?
The InChIKey is BQWBJBFZVWWWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O/c1-11-6-4-9-14(18-11)15(20)19-16(2,3)12-7-5-8-13(17)10-12/h4-10H,1-3H3,(H,19,20).
What are the key properties of N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide?
N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide has a molecular weight of 272.32 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 110472200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).